CAS No.65326-33-2,2-Amino-3-acetylpyridine Suppliers

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Basic Information

Molecular Structure:
CAS No.:	65326-33-2
Name:	2-Amino-3-acetylpyridine
Article Data:	4
Cas Database

Formula:	C₇H₈N₂O
Molecular Weight:	136.153
Synonyms:	1-(2-Aminopyridin-3-yl)ethanone;2-Amino-3-acetylpyridine;3-Acetyl-2-aminopyridine;1-(2-Aminopyridin-3-yl)ethan-1-one;
Density:	1.168 g/cm³
Melting Point:	139-140°C
Boiling Point:	283.8 °C at 760 mmHg
Flash Point:	125.5 °C
Hazard Symbols:	T
PSA:	55.98000
LogP:	1.44760

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Specification

The systematic name of 2-Amino-3-acetylpyridine is 1-(2-aminopyridin-3-yl)ethanone. With the CAS registry number 65326-33-2, it is also named as Ethanone,1-(2-amino-3-pyridinyl)-. The product's category is Pyridine. Besides, it is used as pharmaceutical intermediate. In addition, its molecular formula is C₇H₈N₂O and molecular weight is 136.15.

The other characteristics of 2-Amino-3-acetylpyridine can be summarized as: (1)ACD/LogP: 1.60; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 1.53; (4)ACD/LogD (pH 7.4): 1.6; (5)ACD/BCF (pH 5.5): 8.24; (6)ACD/BCF (pH 7.4): 9.62; (7)ACD/KOC (pH 5.5): 150.61; (8)ACD/KOC (pH 7.4): 175.79; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 55.98 Å²; (13)Index of Refraction: 1.577; (14)Molar Refractivity: 38.6 cm³; (15)Molar Volume: 116.4 cm³; (16)Polarizability: 15.3×10^-24cm³; (17)Surface Tension: 51.7 dyne/cm; (18)Density: 1.168 g/cm³; (19)Flash Point: 125.5 °C; (20)Melting Point: 139-140 °C; (21)Enthalpy of Vaporization: 52.28 kJ/mol; (22)Boiling Point: 283.8 °C at 760 mmHg; (23)Vapour Pressure: 0.00309 mmHg at 25 °C.

People can use the following data to convert to the molecule structure.
(1)SMILES: O=C(C)c1cccnc1N
(2)InChI: InChI=1/C7H8N2O/c1-5(10)6-3-2-4-9-7(6)8/h2-4H,1H3,(H2,8,9)
(3)InChIKey: BNVLGAQNNFJKHG-UHFFFAOYAA
(4)Std. InChI: InChI=1S/C7H8N2O/c1-5(10)6-3-2-4-9-7(6)8/h2-4H,1H3,(H2,8,9)
(5)Std. InChIKey: BNVLGAQNNFJKHG-UHFFFAOYSA-N

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